4-(4-methoxyphenyl)-N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-2-oxidanyl-2-(thian-4-yl)but-3-ynamide

Systemtic Name: 4-(4-methoxyphenyl)-N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-2-oxidanyl-2-(thian-4-yl)but-3-ynamide Openeye Name: 2-hydroxy-4-(4-methoxyphenyl)-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-tetrahydrothiopyran-4-yl-but-3-ynamide CAS Name: 2-hydroxy-4-(4-methoxyphenyl)-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-(4-thianyl)-3-butynamide IUPAC Name: 2-hydroxy-4-(4-methoxyphenyl)-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-(thian-4-yl)but-3-ynamide Traditional Name: 2-hydroxy-N-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-4-(4-methoxyphenyl)-2-tetrahydrothiopyran-4-yl-but-3-ynamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(C#CC3=CC=C(C=C3)OC)(C4CCSCC4)O

Isomeric SMILES

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(C#CC3=CC=C(C=C3)OC)(C4CCSCC4)O

InChI

InChI=1S/C25H24N2O5S/c1-16-22-15-19(5-8-21(22)23(28)32-27-16)26-24(29)25(30,18-10-13-33-14-11-18)12-9-17-3-6-20(31-2)7-4-17/h3-8,15,18,30H,10-11,13-14H2,1-2H3,(H,26,29)